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View the latest research published by CMSP scientists.

Journal article
2025
Recent Developments in DFTB+, a Software Package for Efficient Atomistic Quantum Mechanical Simulations
The Journal of Physical Chemistry A (2025)
B. Hourahine | M. Berdakin | J. A. Bich | F. P. Bonafé | C. Camacho | Q. Cui | M. Y. Deshaye | G. Díaz Mirón | S. Ehlert | M. Elstner | T. Frauenheim | N. Goldman | R. A. González León | T. van der Heide | S. Irle ...
Journal article
2025
Crystallization of L‐Cysteine in Heavy Water Induces Intrinsic Fluorescence
Angewandte Chemie (2025)
Debarshi Banerjee | Sonika Chibh | Om Shanker Tiwari | Gonzalo Díaz Mirón | Marta Monti | Hadar R. Yakir | Shweta Pawar | Dror Fixler | Linda J. W. Shimon | Ehud Gazit | Ali Hassanali
Preprint
2025
Acid Base Chemistry of Short Hydrogen Bonds: A Tale of Schr\'odinger's Cat in Glutamine-Derived Crystals
Muhammad Nawaz Qaisrani | Nandha Kumar | Christian Dreßler | Ralph Gebauer | Ali Hassanali
Preprint
2025
Interplay of entanglement structures and stabilizer entropy in spin models
Michele Viscardi | Marcello Dalmonte | Alioscia Hamma | Emanuele Tirrito
Journal article
2025
Computational Simulations and Strategies for Optimal Hydrogen Storage Materials Design
PRX Energy (2025)
Vikram Mahamiya | Alok Shukla | Abhishek Kumar Adak | Hoonkyung Lee | Nicola Seriani | Ralph Gebauer
Journal article
2025
Monitored long-range interacting systems: spin-wave theory for quantum trajectories
Nature Communications (2025)
Zejian Li | Anna Delmonte | Xhek Turkeshi | Rosario Fazio
Preprint
2025
Chiral Gravitons on the Lattice
Hernan B. Xavier | Zeno Bacciconi | Titas Chanda | Dam Thanh Son | Marcello Dalmonte
Preprint
2025
Family-Vicsek universality of the binary intrinsic dimension of nonequilibrium data
Roberto Verdel | Devendra Singh Bhakuni | Santiago Acevedo
Journal article
2025
Data-Driven Discovery of the Origins of UV Absorption in the Alpha-3C Protein
The Journal of Physical Chemistry B (2025)
Germaine Neza Hozana | Gonzalo Díaz Mirón | Ali Hassanali
Preprint
2025
Local vs non-local dynamics in cavity-coupled Rydberg atom arrays
Zeno Bacciconi | Hernan B. Xavier | Matteo Marinelli | Devendra Singh Bhakuni | Marcello Dalmonte
Journal article
2025
Measurement-induced phase transitions in monitored infinite-range interacting systems
Physical Review Research (2025)
Anna Delmonte | Zejian Li | Gianluca Passarelli | Eric Yilun Song | Diego Barberena | Ana Maria Rey | Rosario Fazio
Journal article
2025
Breaking of Lorentz invariance caused by the interplay between spin-orbit interaction and transverse phonon modes in quantum wires
Physical Review Research (2025)
D. V. Efremov | Weyner Ccuiro | Luis E. F. Foa Torres | M. N. Kiselev

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All publications
Journal article
2022
Using the Environment to Understand non-Markovian Open Quantum Systems
Quantum (2022)
Gerald Fux
Journal article
2022
Heat Conductance Oscillations in Two Weakly Connected Charge Kondo Circuits
Communications in Physics (2022)
Thanh Thi Kim Nguyen | Mikhail Kiselev
Journal article
2022
Thermoelectrics of a two-channel charge Kondo circuit: Role of electron-electron interactions in a quantum point contact
Physical Review B (2022)
A. V. Parafilo | T. K. T. Nguyen | M. N. Kiselev
Journal article
2022
Multistage Kondo effect in a multiterminal geometry: A modular quantum interferometer
ArXiv (2022)
Karki, D. B | Pavlov, Andrei I | Kiselev, Mikhail N
Journal article
2022
Entanglement Hamiltonians: From Field Theory to Lattice Models and Experiments
Annalen der Physik (2022)
Marcello Dalmonte | Viktor Eisler | Marco Falconi | Benoît Vermersch
Preprint
2022
Elastic stripes formation at electronic transitions
Giuliano Chiriacò | Andrew J. Millis
Journal article
2022
Correlation engineering via nonlocal dissipation
Physical Review Research (2022)
Seetharam, K. | Lerose, A. | Fazio, R. | Marino, J.
Journal article
2022
Optimal quantum annealing: A variational shortcut-to-adiabaticity approach
Physical Review A (2022)
Passarelli, G. | Fazio, R. | Lucignano, P.
Journal article
2022
Statistical physics of inhomogeneous transport: Unification of diffusion laws and inference from first-passage statistics.
Physical review. E (2022)
Belousov R | Hassanali A | Roldán É
Journal article
2022
Transition-Based Constrained DFT for the Robust and Reliable Treatment of Excitations in Supramolecular Systems
Journal of Chemical Theory and Computation (2022)
Martina Stella | Kritam Thapa | Luigi Genovese | Laura E. Ratcliff
Journal article
2022
Probing disorder in 2CzPN using core and valence states
Physical Chemistry Chemical Physics (2022)
Nathalie K. Fernando | Martina Stella | William Dawson | Takahito Nakajima | Luigi Genovese | Anna Regoutz | Laura E. Ratcliff
Journal article
2022
Hematite surfaces: Band bending and local electronic states
Physical Review Materials (2022)
Ralph Gebauer | Samare Rostami | N. Seriani | R. Gebauer
Journal article
2022
Oxygen vacancy suppress room temperature ferromagnetism of p-type Cu doped ZnO: Synthesis and density functional theory
Micro and Nanostructures (2022)
Ralph Gebauer | Hassan Ahmoum | Guojian Li | Mourad Boughrara | Ralph Gebauer | Mohd Sukor Su'ait | Karim Tanji | Mohamed Kerouad | Qiang Wang
Journal article
2022
Blue and black phosphorene on metal substrates: a density functional theory study
Journal of Physics: Condensed Matter (2022)
Abhishek K Adak | Devina Sharma | Shobhana Narasimhan
Preprint
2022
Entanglement Hamiltonians: from field theory, to lattice models and experiments
M. Dalmonte | V. Eisler | M. Falconi | B. Vermersch
Preprint
2022
Critical light-matter entanglement at cavity mediated phase transition
Giuliano Chiriacò | Marcello Dalmonte | Titas Chanda
Preprint
2022
Phase diagram of Rydberg-dressed atoms on two-leg triangular ladders
Pierre Fromholz | Mikheil Tsitsishvili | Matteo Votto | Marcello Dalmonte | Alexander Nersesyan | Titas Chanda
Preprint
2022
The Negativity Hamiltonian: An operator characterization of mixed-state entanglement
Sara Murciano | Vittorio Vitale | Marcello Dalmonte | Pasquale Calabrese
Journal article
2022
Localization in the Discrete Non-linear Schrödinger Equation and Geometric Properties of the Microcanonical Surface
Journal of Statistical Physics (2022)
Claudio Arezzo | Federico Balducci | Riccardo Piergallini | Antonello Scardicchio | Carlo Vanoni
Journal article
2022
Localization and Melting of Interfaces in the Two-Dimensional Quantum Ising Model
Physical Review Letters (2022)
Federico Balducci | Andrea Gambassi | Alessio Lerose | Antonello Scardicchio | Carlo Vanoni
Preprint
2022
Elastic stripes formation at electronic transitions
Giuliano Chiriacò | Andrew J. Millis
Preprint
2022
Gauge-theoretic origin of Rydberg quantum spin liquids
P. S. Tarabunga | F. M. Surace | R. Andreoni | A. Angelone | M. Dalmonte
Journal article
2022
Measurement-induced criticality in extended and long-range unitary circuits
SciPost Physics Core (2022)
Marcello Dalmonte
Journal article
2022
Gauge-Theoretic Origin of Rydberg Quantum Spin Liquids
Physical Review Letters (2022)
P. S. Tarabunga | F. M. Surace | R. Andreoni | A. Angelone | M. Dalmonte
Journal article
2022
Negativity Hamiltonian: An Operator Characterization of Mixed-State Entanglement
Physical Review Letters (2022)
Marcello Dalmonte
Journal article
2022
Phase diagram of Rydberg-dressed atoms on two-leg triangular ladders
Physical Review B (2022)
Pierre Fromholz | Mikheil Tsitsishvili | Matteo Votto | Marcello Dalmonte | Alexander Nersesyan | Titas Chanda
Journal article
2022
Symmetry-resolved dynamical purification in synthetic quantum matter
SciPost Physics (2022)
Marcello Dalmonte
Journal article
2022
Critical light-matter entanglement at cavity mediated phase transitions
Physical Review B (2022)
Giuliano Chiriacò | Marcello Dalmonte | Titas Chanda
Journal article
2022
Dissipative Floquet Dynamics: from Steady State to Measurement Induced Criticality in Trapped-ion Chains
Quantum (2022)
Marcello Dalmonte
Journal article
2022
Entanglement transitions from stochastic resetting of non-Hermitian quasiparticles
Physical Review B (2022)
Xhek Turkeshi | Marcello Dalmonte | Rosario Fazio | Marco Schirò

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